Geometry & MOs

Info

ID:	255329
PubChem CID:	103131437
Reduced:	ON3C15H27 (1)
Stoich.:	AB3C15D27 (1)
Weight, g/mol:	279.231063
ΔH_f, kcal/mol:	-26.81
Dipole, Da:	2.72
IP(EA), eV:	-8.8(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-ethoxy-4-methylcyclohexyl)-(1-methylpyrazol-3-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCOC1(CCC(CC1)C)C(C2=NN(C=C2)C)NC

DOS

IR

Vibrations